UCSF

ZINC12358612

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 31 No

Other Names:

MFCD00150747

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.65 -14.34 -12.13 8 11 0 190 454.513 4

Vendor Notes

Note Type Comments Provided By
Melting_Point ca 218? dec. Alfa-Aesar
Melting_Point ca 218° dec. Alfa-Aesar

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )